4-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-1-phenethyl-piperazine-2,6-dione

Systemtic Name: 4-[(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-1-phenethyl-piperazine-2,6-dione Openeye Name: 4-(5-bromo-1-propanoyl-indolin-7-yl)sulfonyl-1-phenethyl-piperazine-2,6-dione CAS Name: 4-[[5-bromo-1-(1-oxopropyl)-2,3-dihydroindol-7-yl]sulfonyl]-1-phenethylpiperazine-2,6-dione IUPAC Name: 4-[(5-bromo-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl]-1-phenethylpiperazine-2,6-dione Traditional Name: 4-(5-bromo-1-propionyl-indolin-7-yl)sulfonyl-1-phenethyl-piperazine-2,6-quinone Formula: C23H24BrN3O5S MolecularWeight: 534.42276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CC(=O)N(C(=O)C3)CCC4=CC=CC=C4)Br

Isomeric SMILES

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CC(=O)N(C(=O)C3)CCC4=CC=CC=C4)Br

InChI

InChI=1S/C23H24BrN3O5S/c1-2-20(28)27-11-9-17-12-18(24)13-19(23(17)27)33(31,32)25-14-21(29)26(22(30)15-25)10-8-16-6-4-3-5-7-16/h3-7,12-13H,2,8-11,14-15H2,1H3